0 mol 0 unq 0 iso 0 dist 7.30381 10.169 8.34244 10.1803 6.0597 6.3267 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 7.18409 14.335 7.60283 13.544 7.47886 8.11206 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 6.21163 8.38749 7.60283 11.6402 7.47886 8.11206 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 7.65758 4.68181 6.84337 7.63645 4.36537 7.17699 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 7.97558 12.0234 9.62637 18.5183 13.1805 8.13782 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 7.88172 15.7855 9.11258 21.1442 13.4366 6.96494 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 7.88172 15.7855 9.11258 16.4219 8.88332 7.01363 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 7.78223 12.097 9.83981 15.5652 9.47219 9.86739 numMergedOcc 0
8 mol 114 unq 1 iso 0 dist 7.78223 12.097 9.83981 19.1805 14.0577 8.39249 numMergedOcc 0
9 mol 114 unq 2 iso 0 dist 7.78223 12.097 9.83981 15.9371 10.6837 8.93623 numMergedOcc 0
10 mol 114 unq 3 iso 0 dist 7.78223 8.59522 6.51395 15.5652 9.47219 9.49413 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 7.80701 4.72977 6.21403 10.2207 7.99114 6.4218 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 9.6281 10.3893 5.81122 11.6317 10.143 6.90155 numMergedOcc 0
13 mol 156 unq 1 iso 0 dist 6.22667 7.02779 5.81122 13.5619 10.143 6.90155 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 9.27911 12.677 9.19117 15.4761 8.00091 6.74517 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 6.53696 8.65486 6.99693 6.84347 4.57622 4.79852 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 9.92671 5.30261 7.10413 14.9899 10.4271 9.86861 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 5.68253 6.7061 7.22019 8.79054 6.56416 5.32183 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 6.20377 10.2924 7.95766 7.29546 4.29892 7.27958 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 5.4347 5.28695 7.02079 10.4752 7.4465 7.25543 numMergedOcc 0
20 mol 250 unq 0 iso 0 dist 9.62767 6.27402 5.97993 14.3073 6.40578 8.86638 numMergedOcc 0
21 mol 250 unq 1 iso 0 dist 9.62767 9.6195 6.44252 14.3073 6.40578 5.94383 numMergedOcc 0
22 mol 250 unq 2 iso 0 dist 9.62767 9.6195 6.44252 15.6069 9.48491 7.88284 numMergedOcc 0
23 mol 250 unq 3 iso 0 dist 5.99119 5.85862 5.97993 10.6177 6.40578 8.86638 numMergedOcc 0
24 mol 250 unq 4 iso 0 dist 5.99119 6.88928 6.44252 10.6177 6.40578 5.94383 numMergedOcc 0
25 mol 250 unq 5 iso 0 dist 5.99119 6.88928 6.44252 10.8627 9.48491 7.88284 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 8.02757 5.84058 8.92185 10.5215 5.19922 8.76313 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 8.02757 5.84058 8.92185 11.278 10.2977 7.4363 numMergedOcc 0
28 mol 280 unq 0 iso 0 dist 9.76712 6.47178 9.18069 10.2507 6.77492 9.69863 numMergedOcc 0
